1-(1-methoxycyclopentyl)prop-2-ynylhydrazine

C9H16N2O — CID 105268683

IUPAC1-(1-methoxycyclopentyl)prop-2-ynylhydrazine
SMILESC#CC(NN)C1(OC)CCCC1
InChIInChI=1S/C9H16N2O/c1-3-8(11-10)9(12-2)6-4-5-7-9/h1,8,11H,4-7,10H2,2H3
InChIKeyQDUVIHOVZDPSBB-UHFFFAOYSA-N
MW168.24 g/mol
LogP0.41
Rot. Bonds3

About 1-(1-methoxycyclopentyl)prop-2-ynylhydrazine

1-(1-methoxycyclopentyl)prop-2-ynylhydrazine (PubChem CID 105268683) has the molecular formula C9H16N2O and a molecular weight of 168.24 g/mol. Its IUPAC name is 1-(1-methoxycyclopentyl)prop-2-ynylhydrazine.

Molecular Properties

Compound Name1-(1-methoxycyclopentyl)prop-2-ynylhydrazine
PubChem CID105268683
Molecular FormulaC9H16N2O
Molecular Weight168.24 g/mol
Exact Mass168.13
IUPAC Name1-(1-methoxycyclopentyl)prop-2-ynylhydrazine
SMILESC#CC(NN)C1(OC)CCCC1
InChIInChI=1S/C9H16N2O/c1-3-8(11-10)9(12-2)6-4-5-7-9/h1,8,11H,4-7,10H2,2H3
InChIKeyQDUVIHOVZDPSBB-UHFFFAOYSA-N
XLogP0.41
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

1-(1-methoxycyclohexyl)prop-2-ynylhydrazine
CID 105276008
1-(1-methoxycyclohexyl)prop-2-yn-1-amine
CID 116762592
1-(1-methoxy-4,4-dimethylcyclohexyl)but-3-ynylhydrazine
CID 105278045
1-(1-methoxycyclohexyl)pent-3-ynylhydrazine
CID 105275981
1-(1-methoxycycloheptyl)butylhydrazine
CID 105278151
1-(1-methoxycycloheptyl)-N-methylbut-3-yn-1-amine
CID 116770145
1-(1-methoxycyclobutyl)pent-3-ynylhydrazine
CID 105270283
[1-(1-methoxycyclopentyl)-4,4-dimethylpentyl]hydrazine
CID 105268753
[2-cyclopropyl-1-(1-methoxycyclohexyl)ethyl]hydrazine
CID 105275891
[1-(1-methoxycyclopentyl)-3-methylbut-3-enyl]hydrazine
CID 105268829
[cyclopropyl-(1-methoxycycloheptyl)methyl]hydrazine
CID 105278128
[4,4,4-trifluoro-1-(1-methoxycyclohexyl)butyl]hydrazine
CID 105275901

Frequently Asked Questions

What is the IUPAC name of 1-(1-methoxycyclopentyl)prop-2-ynylhydrazine?
The IUPAC name of 1-(1-methoxycyclopentyl)prop-2-ynylhydrazine (CID 105268683) is 1-(1-methoxycyclopentyl)prop-2-ynylhydrazine.
What is the SMILES notation for 1-(1-methoxycyclopentyl)prop-2-ynylhydrazine?
The canonical SMILES for 1-(1-methoxycyclopentyl)prop-2-ynylhydrazine is C#CC(NN)C1(OC)CCCC1.
What is the InChIKey of 1-(1-methoxycyclopentyl)prop-2-ynylhydrazine?
The InChIKey is QDUVIHOVZDPSBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O/c1-3-8(11-10)9(12-2)6-4-5-7-9/h1,8,11H,4-7,10H2,2H3.
What are the key properties of 1-(1-methoxycyclopentyl)prop-2-ynylhydrazine?
1-(1-methoxycyclopentyl)prop-2-ynylhydrazine has a molecular weight of 168.24 g/mol, XLogP of 0.41, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methoxycyclopentyl)prop-2-ynylhydrazine is sourced from PubChem (CID 105268683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).